CID 18971485

1-methyl-1h-pyrrole-2-sulfonamide

Structural Information

Molecular Formula
C5H8N2O2S
SMILES
CN1C=CC=C1S(=O)(=O)N
InChI
InChI=1S/C5H8N2O2S/c1-7-4-2-3-5(7)10(6,8)9/h2-4H,1H3,(H2,6,8,9)
InChIKey
CVGYKDZPLVGJAH-UHFFFAOYSA-N
Compound name
1-methylpyrrole-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

160.03065 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.03793 130.2
[M+Na]+ 183.01987 140.5
[M-H]- 159.02337 133.2
[M+NH4]+ 178.06447 151.8
[M+K]+ 198.99381 138.4
[M+H-H2O]+ 143.02791 124.9
[M+HCOO]- 205.02885 149.8
[M+CH3COO]- 219.04450 173.7
[M+Na-2H]- 181.00532 134.0
[M]+ 160.03010 131.7
[M]- 160.03120 131.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe